oxygenated xanthohumol

Properties Image MNX_ID MNXM107484 reference chebi:66333 formula C22H26O7 global charge 0 mol weight 402.443 InChIKey YXGBQKBRCDLZMP-JXMROGBWSA-N InChI InChI=1S/C22H26O7/c1-22(2,29-4)19(26)11-15-17(25)12-18(28-3)20(21(15)27)16(24)10-7-13-5-8-14(23)9-6-13/h5-10,12,19,23,25-27H,11H2,1-4H3/b10-7+ SMILES COC1=CC(O)=C(CC(O)C(C)(C)OC)C(O)=C1C(=O)/C=C/C1=CC=C(O)C=C1 MNX internals InChI (mnx) InChI=1/C22H26O7/c1-22(2,29-4)19(26)11-15-17(25)12-18(28-3)20(21(15)27)16(24)10-7-13-5-8-14(23)9-6-13/h5-10,12,19,23,25-27H,11H2,1-4H3/b10-7+/t19? SMILES (mnx) [CH3:1][C:22]([CH3:2])([CH:19]([CH2:11][C:15]1=[C:21]([OH:27])[C:20]([C:16](/[CH:10]=[CH:7]/[C:13]2=[CH:6][CH:9]=[C:14]([OH:23])[CH:8]=[CH:5]2)=[O:24])=[C:18]([O:28][CH3:3])[CH:12]=[C:17]1[OH:25])[OH:26])[O:29][CH3:4]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0